LN-635145
8-AZAXANTHIN , 98% , 1468-26-4
Update time: 2023-04-23
PRODUCT Properties
| Melting point: | >230°C |
| Boiling point: | 275.98°C (rough estimate) |
| Density | 1.6725 (rough estimate) |
| refractive index | 1.8000 (estimate) |
| pka | 6.44±0.20(Predicted) |
| form | solid |
| BRN | 10424 |
| InChI | 1S/C4H3N5O2.H2O/c10-3-1-2(8-9-7-1)5-4(11)6-3;/h(H3,5,6,7,8,9,10,11);1H2 |
| InChIKey | VKEGPGRANAWNIN-UHFFFAOYSA-N |
| SMILES | O.O=C1NC(=O)c2[nH]nnc2N1 |
| LogP | -1.440 (est) |
| CAS DataBase Reference | 1468-26-4(CAS DataBase Reference) |
Description and Uses
8-Azaxanthine monohydrate has been used to determine the crystal and molecular structure of 1,3-dimethyl-8-azaxanthine (HDAX) monohydrate by X-ray diffraction.
Safety
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H312-H302-H332 |
| Precautionary statements | P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312 |
| PPE | Eyeshields, Gloves, type N95 (US) |
| Safety Statements | 24/25 |
| WGK Germany | 3 |
| RTECS | XZ5950000 |
| F | 10-23 |
| Storage Class | 11 - Combustible Solids |
| Toxicity | LD50 intraperitoneal in mouse: 200mg/kg |
